ChemSpider 2D Image | Ethyl 1-(2-ethoxy-2-oxoethyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylate | C17H20N2O5

Ethyl 1-(2-ethoxy-2-oxoethyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylate

  • Molecular FormulaC17H20N2O5
  • Average mass332.351 Da
  • Monoisotopic mass332.137207 Da
  • ChemSpider ID21119667

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-(2-Éthoxy-2-oxoéthyl)-3-(4-méthoxyphényl)-1H-pyrazole-5-carboxylate d'éthyle [French] [ACD/IUPAC Name]
1H-Pyrazole-1-acetic acid, 5-(ethoxycarbonyl)-3-(4-methoxyphenyl)-, ethyl ester [ACD/Index Name]
Ethyl 1-(2-ethoxy-2-oxoethyl)-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxylate [ACD/IUPAC Name]
Ethyl-1-(2-ethoxy-2-oxoethyl)-3-(4-methoxyphenyl)-1H-pyrazol-5-carboxylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 484.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 246.7±28.7 °C
Index of Refraction: 1.551
Molar Refractivity: 88.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.83
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.62
ACD/KOC (pH 5.5): 649.29
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.62
ACD/KOC (pH 7.4): 649.29
Polar Surface Area: 80 Å2
Polarizability: 34.9±0.5 10-24cm3
Surface Tension: 41.6±7.0 dyne/cm
Molar Volume: 276.2±7.0 cm3

Click to predict properties on the Chemicalize site


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